Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033137
PROPERTIES
| NPAID | NPA033137 |
|---|---|
| CLUSTER ID | 248 |
| NODE ID | 11 |
| NAME | Potashchelin B |
| FORMULA | C43H70N10O22 |
| MOLECULAR WEIGHT (Da) | 1079.0810 |
| ACCURATE MASS (Da) | 1078.4666 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Halomonas |
| ORIGIN SPECIES | sp. MG34 |
| InChIKey | CPRFHUFTLRUMNV-HPBFKGMYSA-N |
| InChI | InChI=1S/C43H70N10O22/c1-3-4-5-6-7-8-9-10-11-14-27(59)50-30(32(61)42(71)72)39(68)48-23(17-54)34(63)44-16-28(60)45-24(18-55)35(64)47-26(20-57)37(66)52-31(33(62)43(73)74)40(69)51-29(21(2)58)38(67)49-25(19-56)36(65)46-22-13-12-15-53(75)41(22)70/h8-9,21-26,29-33,54-58,61-62,75H,3-7,10-20H2,1-2H3,(H,44,63)(H,45,60)(H,46,65)(H,47,64)(H,48,68)(H,49,67)(H,50,59)(H,51,69)(H,52,66)(H,71,72)(H,73,74)/b9-8-/t21-,22+,23-,24-,25+,26+,29-,30+,31+,32+,33-/m1/s1 |
| SMILES | CCCCCC/C=C\CCCC(=O)N[C@H](C(=O)N[C@H](CO)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@H]1CCCN(O)C1=O)[C@@H](C)O)[C@@H](O)C(=O)O)[C@H](O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Li, Yihong; Liu, Li; Zhang, Gengxin; He, Ning; Guo, Wenqiang; Hong, Bin; Xie, Yunying Potashchelins, a Suite of Lipid Siderophores Bearing Both L-threo and L-erythro Beta-Hydroxyaspartic Acids, Acquired From the Potash-Salt-Ore-Derived Extremophile Halomonas sp. MG34 Frontiers in Chemistry 2020 8 (None) None. | ||
|---|---|---|---|
| DOI | 10.3389/fchem.2020.00197 | PMID | 32266214 |
